1TIK
CRYSTAL STRUCTURE OF ACYL CARRIER PROTEIN PHOSPHODIESTERASE
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSLS BEAMLINE X9A |
| Synchrotron site | NSLS |
| Beamline | X9A |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2004-04-30 |
| Detector | MARRESEARCH |
| Wavelength(s) | 0.979 |
| Spacegroup name | P 4 21 2 |
| Unit cell lengths | 94.371, 94.371, 54.605 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 19.680 - 2.300 |
| R-factor | 0.186 |
| Rwork | 0.186 |
| R-free | 0.23200 |
| Structure solution method | SAD |
| Starting model (for MR) | Experimental electron density map |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.100 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | SHARP |
| Refinement software | CNS (1.1) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 25.000 | 2.380 |
| High resolution limit [Å] | 2.300 | 2.300 |
| Number of reflections | 20838 | |
| <I/σ(I)> | 13.99 | 3.88 |
| Completeness [%] | 99.4 | 99.9 |
| Redundancy | 6.22 | 6.17 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.5 | 291 | 7% PEG 4k, 10% MPD, 0.1M Lithium Sulfate, 0.1M 5% Na Cacodylate pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K |
